CID 207258

Brn 2163301

Structural Information

Molecular Formula
C18H32Cl4N2O2
SMILES
CCN(CCCCCCCCCCN(CC)C(=O)C(Cl)Cl)C(=O)C(Cl)Cl
InChI
InChI=1S/C18H32Cl4N2O2/c1-3-23(17(25)15(19)20)13-11-9-7-5-6-8-10-12-14-24(4-2)18(26)16(21)22/h15-16H,3-14H2,1-2H3
InChIKey
GHXBCRVFHMQZEB-UHFFFAOYSA-N
Compound name
2,2-dichloro-N-[10-[(2,2-dichloroacetyl)-ethylamino]decyl]-N-ethylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

448.1218 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 449.12908 205.7
[M+Na]+ 471.11102 207.8
[M-H]- 447.11452 204.3
[M+NH4]+ 466.15562 216.9
[M+K]+ 487.08496 203.0
[M+H-H2O]+ 431.11906 202.0
[M+HCOO]- 493.12000 206.2
[M+CH3COO]- 507.13565 238.8
[M+Na-2H]- 469.09647 198.1
[M]+ 448.12125 213.5
[M]- 448.12235 213.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe